Compound Identification
SMILES
COC1=C2CN3C4N(CC2=C(OC)C2=CC=CC=C12)C(=O)N1CC2=C(OC)C5=CC=CC=C5C(OC)=C2CN(C1C4(C)C)C3=O
InChIKey
InChIKey=HFZQRCAUJAXIQH-UHFFFAOYSA-N
Formula
C35H36N4O6
Mass
608.695
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrimidodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrimidodiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrimidodiazepines
Alternative Parents
Benzodiazepines Naphthalenes Anisoles Pyrimidones Alkyl aryl ethers Diazinanes Ureas Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Pyrimidodiazepine - Naphthalene - Anisole - Phenol ether - Alkyl aryl ether - Pyrimidone - 1,3-diazinane - Pyrimidine - Benzenoid - Urea - Azacycle - Ether - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidodiazepines. These are compounds containing a pyrimidoazepine moiety, which consists of a pyrimidine fused to a piperazine ring by a bond. Pyrimidine is 6-membered ring consisting of five carbon atoms and two nitrogen atoms at ring positions 1 and 3. Diazepine is a 7-membered ring consisting of five carbon atoms and two nitrogen centers.
External Descriptors
Not available